Works matching IS 01928651 AND DT 2016 AND VI 37 AND IP 7

Results: 13

Coming Soon, Volume 37, Issue 7.

Published in:: Journal of Computational Chemistry, 2016, v. 37, n. 7, p. 623, doi. 10.1002/jcc.24133
Publication type:: Article

Table of Contents, Volume 37, Issue 7.

Published in:: Journal of Computational Chemistry, 2016, v. 37, n. 7, p. 626, doi. 10.1002/jcc.24134
Publication type:: Article

Editorial Board, Volume 37, Issue 7.

Published in:: Journal of Computational Chemistry, 2016, v. 37, n. 7, p. 625, doi. 10.1002/jcc.24135
Publication type:: Article

Copyright, Volume 37, Issue 7.

Published in:: Journal of Computational Chemistry, 2016, v. 37, n. 7, p. 624, doi. 10.1002/jcc.24136
Publication type:: Article

Application of zone-folding approach to the first-principles estimation of thermodynamic properties of carbon and ZrS2-based nanotubes.

Published in:

Journal of Computational Chemistry, 2016, v. 37, n. 7, p. 641, doi. 10.1002/jcc.24243

By:

Bandura, Andrei V.;
Porsev, Vitaly V.;
Evarestov, Robert A.

Publication type:

Article

Hierarchical atom type definitions and extensible all-atom force fields.

Published in:

Journal of Computational Chemistry, 2016, v. 37, n. 7, p. 653, doi. 10.1002/jcc.24244

By:

Jin, Zhao;
Yang, Chunwei;
Cao, Fenglei;
Li, Feng;
Jing, Zhifeng;
Chen, Long;
Shen, Zhe;
Xin, Liang;
Tong, Sijia;
Sun, Huai

Publication type:

Article

Moment expansion of the linear density-density response function.

Published in:

Journal of Computational Chemistry, 2016, v. 37, n. 7, p. 665, doi. 10.1002/jcc.24248

By:

Scherrer, Arne;
Sebastiani, Daniel

Publication type:

Article

UV-photoexcitation and ultrafast dynamics of HCFC-132b ( CF2 Cl CH2 Cl).

Published in:

Journal of Computational Chemistry, 2016, v. 37, n. 7, p. 675, doi. 10.1002/jcc.24260

By:

Rodrigues, Gessenildo Pereira;
Ventura, Elizete;
Andrade do Monte, Silmar;
Barbatti, Mario

Publication type:

Article

Theoretical study of excited states of DNA base dimers and tetramers using optimally tuned range-separated density functional theory.

Published in:

Journal of Computational Chemistry, 2016, v. 37, n. 7, p. 684, doi. 10.1002/jcc.24266

By:

Sun, Haitao;
Zhang, Shian;
Zhong, Cheng;
Sun, Zhenrong

Publication type:

Article

Cover Image, Volume 37, Issue 7.

Published in:: Journal of Computational Chemistry, 2016, v. 37, n. 7, p. i, doi. 10.1002/jcc.24330
Publication type:: Article

Cover Image, Volume 37, Issue 7.

Published in:: Journal of Computational Chemistry, 2016, v. 37, n. 7, p. ii, doi. 10.1002/jcc.24330
Publication type:: Article

Cover Image, Volume 37, Issue 7.

Published in:: Journal of Computational Chemistry, 2016, v. 37, n. 7, p. iii, doi. 10.1002/jcc.24330
Publication type:: Article

Free energies of solvation in the context of protein folding: Implications for implicit and explicit solvent models.

Published in:

Journal of Computational Chemistry, 2016, v. 37, n. 7, p. 629, doi. 10.1002/jcc.24235

By:

Cumberworth, Alexander;
Bui, Jennifer M.;
Gsponer, Jörg

Publication type:

Article

Works matching IS 01928651 AND DT 2016 AND VI 37 AND IP 7

Coming Soon, Volume 37, Issue 7.

Table of Contents, Volume 37, Issue 7.

Editorial Board, Volume 37, Issue 7.

Copyright, Volume 37, Issue 7.

Application of zone-folding approach to the first-principles estimation of thermodynamic properties of carbon and ZrS<sub>2</sub>-based nanotubes.

Hierarchical atom type definitions and extensible all-atom force fields.

Moment expansion of the linear density-density response function.

UV-photoexcitation and ultrafast dynamics of HCFC-132b ( CF<sub>2</sub> Cl CH<sub>2</sub> Cl).

Theoretical study of excited states of DNA base dimers and tetramers using optimally tuned range-separated density functional theory.

Cover Image, Volume 37, Issue 7.

Cover Image, Volume 37, Issue 7.

Cover Image, Volume 37, Issue 7.

Free energies of solvation in the context of protein folding: Implications for implicit and explicit solvent models.